(3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-methyl-1-benzothiophene-2-carboxylate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-methyl-1-benzothiophene-2-carboxylate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 3-methylbenzothiophene-2-carboxylate CAS Name: 3-methyl-1-benzothiophene-2-carboxylic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 3-methylbenzothiophene-2-carboxylic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C16H15NO3S MolecularWeight: 301.3602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)OCC3=C(ON=C3C)C

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)OCC3=C(ON=C3C)C

InChI

InChI=1S/C16H15NO3S/c1-9-12-6-4-5-7-14(12)21-15(9)16(18)19-8-13-10(2)17-20-11(13)3/h4-7H,8H2,1-3H3